Bis(cyclopentadienyl)ruthenium(1287-13-4) IR2
Product NameBis(cyclopentadienyl)ruthenium
CAS1287-13-4
Molecular FormulaC10H10Ru10*
Molecular Weight231.26
InChIInChI=1S/2C5H5.Ru/c2*1-2-4-5-3-1;/h2*1-5H;
InChIKey BKEJVRMLCVMJLG-UHFFFAOYSA-N
Smiles[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Ru] |^1:0,1,2,3,4,5,6,7,8,9|
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MassMS-NW-9958 bis(eta-cyclopentadienyl)ruthenium(II) C10H10Ru (Mass of molecular ion: 232)
Source Temperature: 130 °C Sample Temperature: 100 °C Direct, 75 eV
18.0 1.0 101.0 1.2 102.0 2.3 104.0 1.4 111.0 1.1 112.0 1.3 113.0 2.0 114.0 3.2 114.5 2.2 115.0 2.7 115.5 3.1 116.0 6.4 117.0 3.4 137.0 1.5 138.0 2.6 139.0 3.7 140.0 2.8 141.0 3.9 143.0 1.5 150.0 1.0 151.0 1.4 152.0 1.4 153.0 1.4 161.0 3.0 163.0 1.5 164.0 7.0 165.0 7.3 166.0 9.5 167.0 16.9 168.0 1.0 169.0 9.7 175.0 1.2 176.0 1.5 177.0 2.1 178.0 2.4 179.0 1.3 180.0 1.5 200.0 1.1 201.0 2.2 202.0 3.1 203.0 4.5 204.0 5.7 205.0 3.3 206.0 4.6 207.0 1.0 208.0 1.3 226.0 17.1 227.0 3.0 228.0 7.8 229.0 39.3 230.0 43.3 231.0 56.3 232.0 100.0 233.0 10.9 234.0 56.4 235.0 6.2
400 MHz in CDCl3
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1H NMR 399.65 MHz C10 H10 Ru 0.040 g : 0.5 ml CDCl3 bis(eta-cyclopentadienyl)ruthenium(II) 
Assign. Shift(ppm)
A 4.552
Hz ppm Int.1823.49 4.563 37 1819.58 4.553 1000 1814.94 4.542 41
in CDCl3
KBr disc
nujol mull
